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Substance Name: VM 44857
RN: 112125-00-5
InChIKey: UOKFUNLRMUEGHY-HZXSVBQFSA-N

Note

  • Metabolite of milbemycin; from Streptomyces E225.

Molecular Weight

  • 568.746
 
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Names and Synonyms

Name of Substance

  • VM 44857

Synonym

  • VM-44857

Systematic Name

  • Milbemycin B, 5-O-demethyl-28-deoxy-6,28-epoxy-25-(1-methyl-1-propenyl)-, (6R,25S(E))-

Registry Numbers

CAS Registry Number

  • 112125-00-5

System Generated Number

  • 0112125005

Structure Descriptors

InChI

1S/C34H48O7/c1-7-22(4)30-23(5)13-14-33(41-30)18-27-17-26(40-33)12-11-21(3)15-20(2)9-8-10-25-19-38-31-29(35)24(6)16-28(32(36)39-27)34(25,31)37/h7-11,16,20,23,26-31,35,37H,12-15,17-19H2,1-6H3/b9-8+,21-11+,22-7+,25-10+/t20-,23-,26+,27-,28-,29+,30+,31+,33+,34+/m0/s1

InChIKey

UOKFUNLRMUEGHY-HZXSVBQFSA-N

Smiles

C1[C@]2(C[C@@H]3C[C@H](CC=C(C[C@H](C=CC=C4[C@@]5([C@@H](C=C([C@H]([C@H]5OC4)O)C)C(O3)=O)O)C)C)O2)O[C@@H]([C@H](C1)C)\C(C)=C\C